Geometry & MOs

Info

ID:	333512
PubChem CID:	127252064
Reduced:	O3N4C21H22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	394.164105
ΔH_f, kcal/mol:	-80.45
Dipole, Da:	1.82
IP(EA), eV:	-9.51(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-7-[4-(2-phenylacetyl)morpholin-2-yl]pyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CN1C2=C(C=CC(=N2)C3CCN(C3)C(=O)CC4=CC=CC=C4)C(=O)N(C1=O)C

DOS

IR

Vibrations